Methyl 9-decenoate

HCID 1778877CAS 25601-41-6
Substructure searchFind similar structures

Basic information

Standard SMILES
C=CCCCCCCCC(=O)OC
InChIKey
SBIGSHCJXYGFMX-UHFFFAOYSA-N
Molecular formula
C11H20O2
Average molar mass
184.27 g/mol
Monoisotopic mass
184.14632988

Names & identifiers

Preferred name
Methyl 9-decenoate
IUPAC
methyl dec-9-enoate
English name
9-Decenoic acid, methyl ester
Molecular formula
C11H20O2
Molecular weight
184.28

Names & synonyms

methyl 9-decenoate25601-41-69-Decenoic acid, methyl esterDTXSID30365139EC 662-772-0RefChem:157762DTXCID30316181SBIGSHCJXYGFMX-UHFFFAOYSA-Nmethyl dec-9-enoate9-Decenoic acid Methyl estermethyl-9-decenoateMFCD00778388
Show more names
Methyl dec-9-enoate,98% (stabilized with MEHQ)Methyl dec-9-enoate (Stabilized with MEHQ) - [M70344]
4K2M7ZTD5Tmethyl Sdecenoatemethyl 9-decen-1-oate9-Decenoic acid, methyl9-Decenoicacid,methylester9-DAMEUNII-4K2M7ZTD5TMLS001048893

Database identifiers

CAS
25601-41-6
PubChem CID
1778877
DTXSID
DTXSID30365139
ChEMBL
CHEMBL1364550
UNII
4K2M7ZTD5T
EC Number
662-772-0
Nikkaji
J498.751I

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
9
Heavy atoms
13

Experimental & physicochemical properties

Physical DescriptionCBI

Physicochemical properties

Boiling point
123 °C · 123 °C(Press: 21 Torr)
Density
0.883 · 0.883±0.06 g/cm3(Predicted)
vapor pressure
13.37 Pa · 13.37Pa at 25℃
storage temp.
2 · 2-8°C, stored under nitrogen
Appearance
Colorless to light yellow Liquid
InChI
InChI=1S/C11H20O2/c1-3-4-5-6-7-8-9-10-11(12)13-2/h3H,1,4-10H2,2H3

Safety & regulation

GHS classification

GHS Classification · 5 items

This chemical does not meet GHS hazard criteria for 48.7% (38 of 78) of reports.

Warning

H400 (48.7%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]

P273, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 78 reports by companies from 3 notifications to the ECHA C&L Inventory.

Hazard information

Regulatory Information · 3 items

9-Decenoic acid, methyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 9-Decenoic acid, methyl ester are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Status: Active Update: 29-10-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/6249

EPA Safer ChemicalChemical: 9-Methyl decenoate
Hazard Classes and CategoriesAquatic Acute 1 (48.7%)

Safety data

tsca
TSCA listed
Signal word
Warning
Symbol(GHS)
GHS09
Hazard statements
H400
REACH Registrations
Active
Precautionary statements
P273-P391-P501

Chemistry & industry

Uses & manufacturing

U.S. Production2023: <50,000 lb
Use Classification · 2 items

EPA Safer Chemical Functional Use Classes -> Solvents

Safer Chemical Classes -> Green circle - The chemical has been verified to be of low concern

General Manufacturing Information9-Decenoic acid, methyl ester: ACTIVE

Applications

Uses9-Decenoic acid, methyl ester is on the EPA's list of safer chemicals that have been verified as low concern and are commonly used as organic solvents.

Upstream & downstream products

Suppliers45 total

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
清宁生物（江苏博泉生物科技有限公司）19352250998 · [email protected]
SHANDONG OUCHEM CO.,LTD.+86-18506360988 · [email protected]

Related reactions

22 records
New reaction record

Linked notes

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